| CAS Number | 886365-96-4 |
| Catalog Number | AG01AA0G(AGN-PC-0WO5RH) |
| Chemical Name | {1-[3-(Trifluoromethyl)phenyl]cyclopropyl}methanamine |
| IUPAC Name | [1-[3-(trifluoromethyl)phenyl]cyclopropyl]methanamine |
| InChI | InChI=1S/C11H12F3N/c12-11(13,14)9-3-1-2-8(6-9)10(7-15)4-5-10/h1-3,6H,4-5,7,15H2 |
| InChI Key | QLNBDTJGDJMHKX-UHFFFAOYSA-N |
| MDL Number | MFCD07374431 |
| Molecular Formula | C11H12F3N |
| Molecular Weight | 215.2149 |
| SMILES | NCC1(C2=CC=CC(C(F)(F)F)=C2)CC1 |
| Synonyms | {1-[3-(trifluoromethyl)phenyl]cyclopropyl}methanamine,
886365-96-4,
1-[3-(Trifluoromethyl)phenyl]cyclopropanemethanamine,
(1-[3-(TRIFLUOROMETHYL)PHENYL]CYCLOPROPYL)METHANAMINE,
AC1Q53PJ,
CHEMBL3458850,
ZINC20429520,
AKOS009265278,
AB39445,
MCULE-1740311064,
NE13660,
SY188514,
EN300-66709,
MFCD07374431 (95%),
A1-01177,
c-[1-(3-trifluoromethylphenyl)cyclopropyl]methylamine,
Z1815149219,
|
| Complexity | 233 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 215.092g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 15 |
| Hydrogen Bond Acceptor Count | 4 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 215.219g/mol |
| Monoisotopic Mass | 215.092g/mol |
| Rotatable Bond Count | 2 |
| Topological Polar Surface Area | 26A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 2.4 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number